ChemDiv3_003586
TL;DR: ChemDiv3_003586 (CAS 305332-36-9) is a chemical compound with molecular formula C22H25N5 and molecular weight 359.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-(2-piperidin-1-ylethylamino)-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile
Also Known As: ChemDiv3_003586, IDI1_021496, BRD-K70678466-001-01-8, 11-((2-(piperidin-1-yl)ethyl)amino)-2,3-dihydro-1H-benzo[4,5]imidazo[1,2-a]cyclopenta[d]pyridine-4-carbonitrile, 11-[(2-PIPERIDINOETHYL)AMINO]-2,3-DIHYDRO-1H-CYCLOPENTA[4,5]PYRIDO[1,2-A][1,3]BENZIMIDAZOL-4-YL CYANIDE
| Molecular Formula | C22H25N5 |
|---|---|
| Molecular Weight | 359.21 g/mol |
| LogP | 3.74568 |
| Topological Polar Surface Area | 56.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.211 |
| Heavy Atoms | 27 |
| Complexity | 1036.4498 |
Chemical Identifiers
| CAS Number | 305332-36-9 |
|---|---|
| SMILES | C1CCN(CC1)CCNC2=C3CCCC3=C(C4=NC5=CC=CC=C5N24)C#N |
Product Overview
ChemDiv3_003586 (CAS 305332-36-9), with molecular formula C22H25N5 and molecular weight 359.21 g/mol. IUPAC: 16-(2-piperidin-1-ylethylamino)-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile.
Chemical Property Profile of ChemDiv3_003586
Property Insights of ChemDiv3_003586
The XLogP value of 3.74568 indicates that ChemDiv3_003586 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.36 Ų, ChemDiv3_003586 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_003586 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv3_003586?
The CAS number of ChemDiv3_003586 is 305332-36-9.
What is the molecular formula of ChemDiv3_003586?
The molecular formula of ChemDiv3_003586 is C22H25N5.
What is the molecular weight of ChemDiv3_003586?
The molecular weight of ChemDiv3_003586 is 359.21 g/mol.
Where can I buy ChemDiv3_003586?
You can request a quote for ChemDiv3_003586 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003586?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003586 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.